Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "5b2f6f49ef55dea9ea5e1c67c898cda8",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.728,
"b": 88.728,
"c": 39.506,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.360,0.990],
"number_observations": 1092526,
"number_observations_unique": 169827,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 15.100
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.010,0.990],
"number_observations": 37862,
"number_observations_unique": 7699,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.888
},
{
"type": "R(meas)",
"value": 2.112
},
{
"type": "R(pim)",
"value": 0.926
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 91.400
},
{
"type": "Redundancy",
"value": 4.900
},
{
"type": "CC(1/2)",
"value": 0.500
}
]
},
{
"resolution_limits": [44.360,5.420],
"number_observations": 7951,
"number_observations_unique": 1132,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 61.900
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}